7-methyl-3-propan-2-ylsulfanyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-5-one

Systemtic Name: 7-methyl-3-propan-2-ylsulfanyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-5-one Openeye Name: 3-isopropylsulfanyl-7-methyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-5-one CAS Name: 7-methyl-3-(propan-2-ylthio)-1H-[1,2,4]triazolo[4,3-a]pyrimidin-5-one IUPAC Name: 7-methyl-3-propan-2-ylsulfanyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-5-one Traditional Name: 3-(isopropylthio)-7-methyl-1H-[1,2,4]triazolo[4,3-a]pyrimidin-5-one Formula: C9H12N4OS MolecularWeight: 224.28278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N2C(=N1)NN=C2SC(C)C

Isomeric SMILES

CC1=CC(=O)N2C(=N1)NN=C2SC(C)C

InChI

InChI=1S/C9H12N4OS/c1-5(2)15-9-12-11-8-10-6(3)4-7(14)13(8)9/h4-5H,1-3H3,(H,10,11)